[5-(cyclohexylmethoxy)-1H-indol-2-yl]-(1H-indol-2-yl)methanone

C24H24N2O2 — CID 5330542

IUPAC[5-(cyclohexylmethoxy)-1H-indol-2-yl]-(1H-indol-2-yl)methanone
SMILESO=C(c1cc2ccccc2[nH]1)c1cc2cc(OCC3CCCCC3)ccc2[nH]1
InChIInChI=1S/C24H24N2O2/c27-24(22-13-17-8-4-5-9-20(17)25-22)23-14-18-12-19(10-11-21(18)26-23)28-15-16-6-2-1-3-7-16/h4-5,8-14,16,25-26H,1-3,6-7,15H2
InChIKeyHRNOZQIWUKARCY-UHFFFAOYSA-N
MW372.47 g/mol
LogP5.84
Rot. Bonds5

About [5-(cyclohexylmethoxy)-1H-indol-2-yl]-(1H-indol-2-yl)methanone

[5-(cyclohexylmethoxy)-1H-indol-2-yl]-(1H-indol-2-yl)methanone (PubChem CID 5330542) has the molecular formula C24H24N2O2 and a molecular weight of 372.47 g/mol. Its IUPAC name is [5-(cyclohexylmethoxy)-1H-indol-2-yl]-(1H-indol-2-yl)methanone.

Molecular Properties

Compound Name[5-(cyclohexylmethoxy)-1H-indol-2-yl]-(1H-indol-2-yl)methanone
PubChem CID5330542
Molecular FormulaC24H24N2O2
Molecular Weight372.47 g/mol
Exact Mass372.18
IUPAC Name[5-(cyclohexylmethoxy)-1H-indol-2-yl]-(1H-indol-2-yl)methanone
SMILESO=C(c1cc2ccccc2[nH]1)c1cc2cc(OCC3CCCCC3)ccc2[nH]1
InChIInChI=1S/C24H24N2O2/c27-24(22-13-17-8-4-5-9-20(17)25-22)23-14-18-12-19(10-11-21(18)26-23)28-15-16-6-2-1-3-7-16/h4-5,8-14,16,25-26H,1-3,6-7,15H2
InChIKeyHRNOZQIWUKARCY-UHFFFAOYSA-N
XLogP5.84
TPSA57.88 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500372.47
LogP ≤ 55.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

ethyl 5-(cyclopentylmethoxy)-1H-indole-2-carboxylate
CID 139270847
bis(5-phenylmethoxy-1H-indol-2-yl)methanone
CID 11698527
6-(cyclopropylmethoxy)-1H-quinolin-2-one
CID 68861342
[2-(1H-indole-2-carbonyl)-1H-indol-5-yl] 3-phenylpropanoate
CID 5330553
[2-(1H-indole-2-carbonyl)-1H-indol-5-yl] 3-phenylprop-2-enoate
CID 78386718
(6-methyl-1H-indol-2-yl)-(5-phenylmethoxy-1H-indol-2-yl)methanone
CID 11625102
methyl 5-[(2,2-dimethyl-1,3-dioxan-5-yl)methoxy]-1H-indole-2-carboxylate
CID 59451360
N-(cyclohexylmethyl)-5-(difluoromethoxy)-N-ethyl-1H-indole-2-carboxamide
CID 158927185
[2-(cyclohexylcarbamoylamino)-2-oxoethyl] 1H-indole-2-carboxylate
CID 7722844
N-[1-(cyclohexylmethylamino)-3-hydroxy-1-oxopropan-2-yl]-1H-indole-2-carboxamide
CID 3618702
[4-(2-cyclohexylethyl)piperazin-1-yl]-(1H-indol-2-yl)methanone
CID 22660610
[2-(cyclopentylamino)-2-oxoethyl] 1H-indole-2-carboxylate
CID 7723573

Frequently Asked Questions

What is the IUPAC name of [5-(cyclohexylmethoxy)-1H-indol-2-yl]-(1H-indol-2-yl)methanone?
The IUPAC name of [5-(cyclohexylmethoxy)-1H-indol-2-yl]-(1H-indol-2-yl)methanone (CID 5330542) is [5-(cyclohexylmethoxy)-1H-indol-2-yl]-(1H-indol-2-yl)methanone.
What is the SMILES notation for [5-(cyclohexylmethoxy)-1H-indol-2-yl]-(1H-indol-2-yl)methanone?
The canonical SMILES for [5-(cyclohexylmethoxy)-1H-indol-2-yl]-(1H-indol-2-yl)methanone is O=C(c1cc2ccccc2[nH]1)c1cc2cc(OCC3CCCCC3)ccc2[nH]1.
What is the InChIKey of [5-(cyclohexylmethoxy)-1H-indol-2-yl]-(1H-indol-2-yl)methanone?
The InChIKey is HRNOZQIWUKARCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O2/c27-24(22-13-17-8-4-5-9-20(17)25-22)23-14-18-12-19(10-11-21(18)26-23)28-15-16-6-2-1-3-7-16/h4-5,8-14,16,25-26H,1-3,6-7,15H2.
What are the key properties of [5-(cyclohexylmethoxy)-1H-indol-2-yl]-(1H-indol-2-yl)methanone?
[5-(cyclohexylmethoxy)-1H-indol-2-yl]-(1H-indol-2-yl)methanone has a molecular weight of 372.47 g/mol, XLogP of 5.84, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(cyclohexylmethoxy)-1H-indol-2-yl]-(1H-indol-2-yl)methanone is sourced from PubChem (CID 5330542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).